Vitas-M small molecule compound
methyl 2-({[(1,3-dimethyl-1H-pyrazol-4-yl)methyl](methyl)carbamothioyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK436990
SMILES COC(=O)c1c(NC(=S)N(Cc2cn(nc2C)C)C)sc2c1CCC(C2)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H26N4O2S2 MW 406.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N4O2S2/c1-11-6-7-14-15(8-11)27-17(16(14)18(24)25-5)20-19(26)22(3)9-13-10-23(4)21-12(13)2/h10-11H,6-9H2,1-5H3,(H,20,26)InChIKey
CJGMRTHSCIYBPF-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=S)N(C)CC3=CN(N=C3C)C
InChI=1SC19H26N4O2S2c111671415(811)2717(16(14)18(24)255)2019(26)22(3)9131023(4)2112(13)2h1011H69H215H3(H2026)
methyl2((((13dimethyl1Hpyrazol4yl)methyl)(methyl)carbamothioyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2(((13dimethylpyrazol4yl)methylmethylcarbamothioyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD03945298
ZINC000006232920
ZINC000006232921
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